CID 477940

2-[6-(4-chlorophenyl)imidazo[2,1-b]thiazol-3-yl]-n-[(4-methylcyclohexylidene)amino]acetamide

Structural Information

Molecular Formula
C20H21ClN4OS
SMILES
CC1CCC(=NNC(=O)CC2=CSC3=NC(=CN23)C4=CC=C(C=C4)Cl)CC1
InChI
InChI=1S/C20H21ClN4OS/c1-13-2-8-16(9-3-13)23-24-19(26)10-17-12-27-20-22-18(11-25(17)20)14-4-6-15(21)7-5-14/h4-7,11-13H,2-3,8-10H2,1H3,(H,24,26)
InChIKey
RBYBDGXYTBENPU-UHFFFAOYSA-N
Compound name
2-[6-(4-chlorophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-[(4-methylcyclohexylidene)amino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

400.11246 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 401.11974 195.7
[M+Na]+ 423.10168 204.1
[M-H]- 399.10518 205.6
[M+NH4]+ 418.14628 210.4
[M+K]+ 439.07562 197.2
[M+H-H2O]+ 383.10972 187.3
[M+HCOO]- 445.11066 209.0
[M+CH3COO]- 459.12631 205.7
[M+Na-2H]- 421.08713 193.3
[M]+ 400.11191 199.3
[M]- 400.11301 199.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.